Structure 9012400

9012399 << 9012400 >> 9012401
Original COD entry Download CIF Download DOT

Citation: Kolitsch, U.; Pring, A.; Tiekink, E. R. T. (2000). Johntomaite, a new member of the bjarebyite group of barium phosphates: description and structure refinement Locality: Spring Creek copper mine, southern Flinders Ranges, South Australia. Mineralogy and Petrology, 70, pp. 1-14.

Formula: Ba Ca0.3 Fe3.7 H3 O15 P3

Cell parameters:

  • a = 9.200 Å
  • b = 12.369 Å
  • c = 5.003 Å
  • α = 90°
  • β = 100.21°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: Ca4 Fe8 O30 P6 (Ca2 Fe4 O15 P3)

Multiplicity: 1

Coordination sequences:

  • 1, 6, 8, 26, 22, 77, 52, 154, 94, 275
  • 2, 8, 9, 37, 30, 90, 55, 174, 105, 296
  • 2, 8, 9, 38, 31, 95, 62, 183, 106, 303
  • 2, 9, 10, 37, 29, 92, 63, 186, 106, 306
  • 2, 9, 11, 40, 33, 106, 64, 189, 109, 309
  • 2, 10, 11, 37, 31, 104, 62, 176, 109, 317
  • 3, 13, 12, 43, 35, 111, 68, 193, 113, 331
  • 3, 14, 12, 37, 32, 114, 67, 184, 111, 325
  • 3, 14, 13, 41, 33, 104, 67, 210, 116, 310
  • 3, 14, 15, 48, 33, 106, 71, 218, 118, 311
  • 4, 5, 25, 22, 71, 51, 154, 86, 245, 145
  • 4, 6, 29, 24, 67, 44, 152, 94, 263, 142
  • 6, 7, 25, 22, 79, 51, 147, 90, 264, 141
  • 7, 8, 26, 22, 77, 52, 154, 94, 275, 140
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